2-methyl-N-[[1-[(2-methyltetrazol-5-yl)methyl]cyclopropyl]methyl]propan-1-amine

C11H21N5 — CID 107053306

IUPAC2-methyl-N-[[1-[(2-methyltetrazol-5-yl)methyl]cyclopropyl]methyl]propan-1-amine
SMILESCC(C)CNCC1(Cc2nnn(C)n2)CC1
InChIInChI=1S/C11H21N5/c1-9(2)7-12-8-11(4-5-11)6-10-13-15-16(3)14-10/h9,12H,4-8H2,1-3H3
InChIKeyGVDSXHGEKWIXRQ-UHFFFAOYSA-N
MW223.32 g/mol
LogP0.78
Rot. Bonds6

About 2-methyl-N-[[1-[(2-methyltetrazol-5-yl)methyl]cyclopropyl]methyl]propan-1-amine

2-methyl-N-[[1-[(2-methyltetrazol-5-yl)methyl]cyclopropyl]methyl]propan-1-amine (PubChem CID 107053306) has the molecular formula C11H21N5 and a molecular weight of 223.32 g/mol. Its IUPAC name is 2-methyl-N-[[1-[(2-methyltetrazol-5-yl)methyl]cyclopropyl]methyl]propan-1-amine.

Molecular Properties

Compound Name2-methyl-N-[[1-[(2-methyltetrazol-5-yl)methyl]cyclopropyl]methyl]propan-1-amine
PubChem CID107053306
Molecular FormulaC11H21N5
Molecular Weight223.32 g/mol
Exact Mass223.18
IUPAC Name2-methyl-N-[[1-[(2-methyltetrazol-5-yl)methyl]cyclopropyl]methyl]propan-1-amine
SMILESCC(C)CNCC1(Cc2nnn(C)n2)CC1
InChIInChI=1S/C11H21N5/c1-9(2)7-12-8-11(4-5-11)6-10-13-15-16(3)14-10/h9,12H,4-8H2,1-3H3
InChIKeyGVDSXHGEKWIXRQ-UHFFFAOYSA-N
XLogP0.78
TPSA55.63 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.32
LogP ≤ 50.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-[[1-[(2-methyltetrazol-5-yl)methyl]cyclopropyl]methyl]ethanamine
CID 107053296
2-methoxy-N-[[4-[(2-methyltetrazol-5-yl)methyl]oxan-4-yl]methyl]ethanamine
CID 107053257
N-[[3-[(2-methyltetrazol-5-yl)methyl]oxolan-3-yl]methyl]propan-2-amine
CID 107053238
2-methyl-N-[[1-[(1-methyltriazol-4-yl)methyl]cyclobutyl]methyl]propan-1-amine
CID 107053273
1-[(2-methyltetrazol-5-yl)methyl]cyclopropane-1-carbaldehyde
CID 131054132
2-ethyl-N-[(2-methyltetrazol-5-yl)methyl]butan-1-amine
CID 107042740
2,3,3-trimethyl-N-[(2-methyltetrazol-5-yl)methyl]butan-1-amine
CID 107042638
1-[[(2-methyltetrazol-5-yl)methylamino]methyl]cyclopentan-1-ol
CID 107042475
2-methyl-N-[(1-propylcyclobutyl)methyl]propan-1-amine
CID 65196170
[3-[(2-methyltetrazol-5-yl)methyl]-3-bicyclo[3.1.0]hexanyl]methanamine
CID 107053508
1-(2-methylpropyl)-2-[(2-methyltetrazol-5-yl)methyl]guanidine
CID 120603258
1-(1-ethoxy-4,4-dimethylcyclohexyl)-N-methyl-2-(2-methyltetrazol-5-yl)ethanamine
CID 107051205

Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-[[1-[(2-methyltetrazol-5-yl)methyl]cyclopropyl]methyl]propan-1-amine?
The IUPAC name of 2-methyl-N-[[1-[(2-methyltetrazol-5-yl)methyl]cyclopropyl]methyl]propan-1-amine (CID 107053306) is 2-methyl-N-[[1-[(2-methyltetrazol-5-yl)methyl]cyclopropyl]methyl]propan-1-amine.
What is the SMILES notation for 2-methyl-N-[[1-[(2-methyltetrazol-5-yl)methyl]cyclopropyl]methyl]propan-1-amine?
The canonical SMILES for 2-methyl-N-[[1-[(2-methyltetrazol-5-yl)methyl]cyclopropyl]methyl]propan-1-amine is CC(C)CNCC1(Cc2nnn(C)n2)CC1.
What is the InChIKey of 2-methyl-N-[[1-[(2-methyltetrazol-5-yl)methyl]cyclopropyl]methyl]propan-1-amine?
The InChIKey is GVDSXHGEKWIXRQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21N5/c1-9(2)7-12-8-11(4-5-11)6-10-13-15-16(3)14-10/h9,12H,4-8H2,1-3H3.
What are the key properties of 2-methyl-N-[[1-[(2-methyltetrazol-5-yl)methyl]cyclopropyl]methyl]propan-1-amine?
2-methyl-N-[[1-[(2-methyltetrazol-5-yl)methyl]cyclopropyl]methyl]propan-1-amine has a molecular weight of 223.32 g/mol, XLogP of 0.78, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-[[1-[(2-methyltetrazol-5-yl)methyl]cyclopropyl]methyl]propan-1-amine is sourced from PubChem (CID 107053306), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).